Decomposition Mechanism of Hexanitrohexaazaisowurtzitane (CL-20) by Coupled Computational and Experimental Study

A novel degradation pathway of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane (CL-20) was identified using computational and experimental methods. Density functional theory (DFT) calculations were employed to obtain its unimolecular degradation pathway, and ultrahigh-performance liquid c...

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Veröffentlicht in:	The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory Molecules, spectroscopy, kinetics, environment, & general theory, 2019-05, Vol.123 (18), p.4014-4020
Hauptverfasser:	Kumar, Macharla Arun, Ashutosh, Parimi, Vargeese, Anuj A
Format:	Artikel
Sprache:	eng
Online-Zugang:	Volltext
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